PUBCHEM-ZINC04127926 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -1.8880 0.6010 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 0.7810 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 1.6340 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 2.9380 3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 3.5510 4.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 4.7210 4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 5.2940 3.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 4.7240 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 3.5430 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 2.9160 0.8440 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6760 2.7460 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 3.8560 -0.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2110 4.9020 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 3.8040 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 3.4750 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 3.3500 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7690 3.5710 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 3.9280 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8040 4.0740 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 4.4100 2.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 5.8080 2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9090 4.1350 2.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3260 4.0470 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 3.2800 -2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 2.9460 -3.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 3.4890 -1.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 5.1770 1.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 6.3000 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 6.4310 3.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 6.5010 5.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 5.4180 5.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -0.3630 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 0.4770 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 1.0570 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 0.5970 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 -0.1760 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 1.8280 3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 1.0840 4.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 3.1200 5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3960 3.0810 -2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8430 3.4570 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 6.4080 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 6.0750 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 6.0430 3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7260 4.2650 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7340 4.7900 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6450 3.0350 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 7.2010 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 6.1010 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 6.4760 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 6.4820 5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 7.4480 5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 1.4850 0.9390 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2710 1.5910 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 53 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 53 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END